| CAS Number | 1354962-61-0 |
| Catalog Number | AG019SE6 |
| Chemical Name | 3-amino-2-[(4-fluorophenyl)methyl]propan-1-ol hydrochloride |
| IUPAC Name | 2-(aminomethyl)-3-(4-fluorophenyl)propan-1-ol;hydrochloride |
| InChI | InChI=1S/C10H14FNO.ClH/c11-10-3-1-8(2-4-10)5-9(6-12)7-13;/h1-4,9,13H,5-7,12H2;1H |
| InChI Key | JCVSTUFFZWQFTE-UHFFFAOYSA-N |
| MDL Number | MFCD20502056 |
| Molecular Formula | C10H15ClFNO |
| Molecular Weight | 219.6836 |
| SMILES | Cl.NCC(CC1=CC=C(F)C=C1)CO |
| Synonyms | 3-amino-2-[(4-fluorophenyl)methyl]propan-1-ol hydrochloride,
1354962-61-0,
NE49437,
EN300-93294,
|
| Complexity | 135 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.083g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.684g/mol |
| Monoisotopic Mass | 219.083g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number